2-bromanyl-6-methoxy-4-[[(4-methylpiperazin-4-ium-1-yl)amino]methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 2-bromanyl-6-methoxy-4-[[(4-methylpiperazin-4-ium-1-yl)amino]methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 2-bromo-6-methoxy-4-[[(4-methylpiperazin-4-ium-1-yl)amino]methylene]cyclohexa-2,5-dien-1-one CAS Name: 2-bromo-6-methoxy-4-[[(4-methyl-1-piperazin-4-iumyl)amino]methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 2-bromo-6-methoxy-4-[[(4-methylpiperazin-4-ium-1-yl)amino]methylidene]cyclohexa-2,5-dien-1-one Traditional Name: 2-bromo-6-methoxy-4-[[(4-methylpiperazin-4-ium-1-yl)amino]methylene]cyclohexa-2,5-dien-1-one Formula: C13H19BrN3O2+ MolecularWeight: 329.21286

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC=C2C=C(C(=O)C(=C2)Br)OC

Isomeric SMILES

C[NH+]1CCN(CC1)NC=C2C=C(C(=O)C(=C2)Br)OC

InChI

InChI=1S/C13H18BrN3O2/c1-16-3-5-17(6-4-16)15-9-10-7-11(14)13(18)12(8-10)19-2/h7-9,15H,3-6H2,1-2H3/p+1